methyl 4-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate

Systemtic Name: methyl 4-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate Openeye Name: methyl 4-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate CAS Name: 4-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(2-hydroxyethyl)sulfamoyl]benzoate Traditional Name: 4-[2-hydroxyethyl-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]sulfamoyl]benzoic acid methyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCO)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C2C=C(C(=O)NC2=C(C=C1)C)CN(CCO)S(=O)(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O6S/c1-14-4-5-15(2)20-19(14)12-17(21(26)23-20)13-24(10-11-25)31(28,29)18-8-6-16(7-9-18)22(27)30-3/h4-9,12,25H,10-11,13H2,1-3H3,(H,23,26)